5-[(5-bromanyl-2-ethoxy-phenyl)carbonylcarbamothioylamino]-2-chloranyl-N-cyclohexyl-benzamide

Systemtic Name: 5-[(5-bromanyl-2-ethoxy-phenyl)carbonylcarbamothioylamino]-2-chloranyl-N-cyclohexyl-benzamide Openeye Name: 5-[(5-bromo-2-ethoxy-benzoyl)carbamothioylamino]-2-chloro-N-cyclohexyl-benzamide CAS Name: 5-[[[[(5-bromo-2-ethoxyphenyl)-oxomethyl]amino]-sulfanylidenemethyl]amino]-2-chloro-N-cyclohexylbenzamide IUPAC Name: 5-[(5-bromo-2-ethoxybenzoyl)carbamothioylamino]-2-chloro-N-cyclohexylbenzamide Traditional Name: 5-[(5-bromo-2-ethoxy-benzoyl)thiocarbamoylamino]-2-chloro-N-cyclohexyl-benzamide Formula: C23H25BrClN3O3S MolecularWeight: 538.8849

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)Br)C(=O)NC(=S)NC2=CC(=C(C=C2)Cl)C(=O)NC3CCCCC3

Isomeric SMILES

CCOC1=C(C=C(C=C1)Br)C(=O)NC(=S)NC2=CC(=C(C=C2)Cl)C(=O)NC3CCCCC3

InChI

InChI=1S/C23H25BrClN3O3S/c1-2-31-20-11-8-14(24)12-18(20)22(30)28-23(32)27-16-9-10-19(25)17(13-16)21(29)26-15-6-4-3-5-7-15/h8-13,15H,2-7H2,1H3,(H,26,29)(H2,27,28,30,32)